N-(4-methylthiophen-3-yl)-2-(5-propan-2-yl-1,3,4-oxadiazol-2-yl)morpholine-4-carboxamide

C15H20N4O3S — CID 128992225

About N-(4-methylthiophen-3-yl)-2-(5-propan-2-yl-1,3,4-oxadiazol-2-yl)morpholine-4-carboxamide

N-(4-methylthiophen-3-yl)-2-(5-propan-2-yl-1,3,4-oxadiazol-2-yl)morpholine-4-carboxamide (PubChem CID 128992225) has the molecular formula C15H20N4O3S and a molecular weight of 336.42 g/mol. Its IUPAC name is N-(4-methylthiophen-3-yl)-2-(5-propan-2-yl-1,3,4-oxadiazol-2-yl)morpholine-4-carboxamide.

Molecular Properties

• Compound Name: N-(4-methylthiophen-3-yl)-2-(5-propan-2-yl-1,3,4-oxadiazol-2-yl)morpholine-4-carboxamide
• PubChem CID: 128992225
• Molecular Formula: C15H20N4O3S
• Molecular Weight: 336.42 g/mol
• Exact Mass: 336.13
• IUPAC Name: N-(4-methylthiophen-3-yl)-2-(5-propan-2-yl-1,3,4-oxadiazol-2-yl)morpholine-4-carboxamide
• SMILES: Cc1cscc1NC(=O)N1CCOC(c2nnc(C(C)C)o2)C1
• InChI: InChI=1S/C15H20N4O3S/c1-9(2)13-17-18-14(22-13)12-6-19(4-5-21-12)15(20)16-11-8-23-7-10(11)3/h7-9,12H,4-6H2,1-3H3,(H,16,20)
• InChIKey: LXHDZOWUJMPOMH-UHFFFAOYSA-N
• XLogP: 3.17
• TPSA: 80.49 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 6
• Rotatable Bonds: 3
• Heavy Atoms: 23
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	336.42
LogP ≤ 5	3.17
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	6

Frequently Asked Questions

What is the IUPAC name of N-(4-methylthiophen-3-yl)-2-(5-propan-2-yl-1,3,4-oxadiazol-2-yl)morpholine-4-carboxamide?

The IUPAC name of N-(4-methylthiophen-3-yl)-2-(5-propan-2-yl-1,3,4-oxadiazol-2-yl)morpholine-4-carboxamide (CID 128992225) is N-(4-methylthiophen-3-yl)-2-(5-propan-2-yl-1,3,4-oxadiazol-2-yl)morpholine-4-carboxamide.

What is the SMILES notation for N-(4-methylthiophen-3-yl)-2-(5-propan-2-yl-1,3,4-oxadiazol-2-yl)morpholine-4-carboxamide?

The canonical SMILES for N-(4-methylthiophen-3-yl)-2-(5-propan-2-yl-1,3,4-oxadiazol-2-yl)morpholine-4-carboxamide is Cc1cscc1NC(=O)N1CCOC(c2nnc(C(C)C)o2)C1.

What is the InChIKey of N-(4-methylthiophen-3-yl)-2-(5-propan-2-yl-1,3,4-oxadiazol-2-yl)morpholine-4-carboxamide?

The InChIKey is LXHDZOWUJMPOMH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N4O3S/c1-9(2)13-17-18-14(22-13)12-6-19(4-5-21-12)15(20)16-11-8-23-7-10(11)3/h7-9,12H,4-6H2,1-3H3,(H,16,20).

What are the key properties of N-(4-methylthiophen-3-yl)-2-(5-propan-2-yl-1,3,4-oxadiazol-2-yl)morpholine-4-carboxamide?

N-(4-methylthiophen-3-yl)-2-(5-propan-2-yl-1,3,4-oxadiazol-2-yl)morpholine-4-carboxamide has a molecular weight of 336.42 g/mol, XLogP of 3.17, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.

Where does this data come from?

All data for N-(4-methylthiophen-3-yl)-2-(5-propan-2-yl-1,3,4-oxadiazol-2-yl)morpholine-4-carboxamide is sourced from PubChem (CID 128992225), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).